6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid

C12H17N3O4S — CID 63641694

IUPAC6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid
SMILESCC1CCCCN1S(=O)(=O)Nc1cccc(C(=O)O)n1
InChIInChI=1S/C12H17N3O4S/c1-9-5-2-3-8-15(9)20(18,19)14-11-7-4-6-10(13-11)12(16)17/h4,6-7,9H,2-3,5,8H2,1H3,(H,13,14)(H,16,17)
InChIKeyQYKBSGZHKPCZAE-UHFFFAOYSA-N
MW299.35 g/mol
LogP1.31
Rot. Bonds4

About 6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid

6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid (PubChem CID 63641694) has the molecular formula C12H17N3O4S and a molecular weight of 299.35 g/mol. Its IUPAC name is 6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid
PubChem CID63641694
Molecular FormulaC12H17N3O4S
Molecular Weight299.35 g/mol
Exact Mass299.09
IUPAC Name6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid
SMILESCC1CCCCN1S(=O)(=O)Nc1cccc(C(=O)O)n1
InChIInChI=1S/C12H17N3O4S/c1-9-5-2-3-8-15(9)20(18,19)14-11-7-4-6-10(13-11)12(16)17/h4,6-7,9H,2-3,5,8H2,1H3,(H,13,14)(H,16,17)
InChIKeyQYKBSGZHKPCZAE-UHFFFAOYSA-N
XLogP1.31
TPSA99.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.35
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid
CID 63651770
2-[(2-methylpiperidin-1-yl)sulfonylamino]benzoic acid
CID 43210819
3-methyl-2-[(2-methylpiperidin-1-yl)sulfonylamino]benzoic acid
CID 43107263
methyl 3-[(2-methylpiperidin-1-yl)sulfonylamino]benzoate
CID 43624206
N-(5-ethyl-1H-pyrazol-3-yl)-2-methylpiperidine-1-sulfonamide
CID 104620642
2-chloro-5-[(2-methylpiperidin-1-yl)sulfonylamino]benzoic acid
CID 60862727
2-methyl-N-phenacylpiperidine-1-sulfonamide
CID 64994247
6-(benzenesulfonamido)pyridine-2-carboxylic acid
CID 5263740
6-[[(2S)-1-[(2R)-2-methylpiperidin-1-yl]-1-oxopropan-2-yl]amino]pyridine-2-carboxamide
CID 97349074
3-methyl-5-[(2-methylpiperidin-1-yl)sulfonylamino]-1,2-thiazole-4-carboxylic acid
CID 60869218
2-[(2-methylpiperidin-1-yl)sulfonylamino]-2-phenylethanethioamide
CID 61123891
2-methyl-N-[3-(methylaminomethyl)phenyl]piperidine-1-sulfonamide
CID 43606211

Frequently Asked Questions

What is the IUPAC name of 6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid?
The IUPAC name of 6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid (CID 63641694) is 6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid?
The canonical SMILES for 6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid is CC1CCCCN1S(=O)(=O)Nc1cccc(C(=O)O)n1.
What is the InChIKey of 6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid?
The InChIKey is QYKBSGZHKPCZAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O4S/c1-9-5-2-3-8-15(9)20(18,19)14-11-7-4-6-10(13-11)12(16)17/h4,6-7,9H,2-3,5,8H2,1H3,(H,13,14)(H,16,17).
What are the key properties of 6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid?
6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid has a molecular weight of 299.35 g/mol, XLogP of 1.31, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid is sourced from PubChem (CID 63641694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).